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       **Program REFINE Version 3.0**  Kurt Bartelmehs and Bob Downs, 1998
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 R060895
 
 Symmetry constraint is: HEXAGONAL   
 
 Wavelength #1 =  1.541838
 Wavelength #2 =  1.540562
 Wavelength #3 =  1.544390
 
 Refinement after correcting for machine error
  
 MACHINE ERROR:   -0.029
  
         OBSERVED                         CALCULATED          DIFFERENCE
    2theta      d     h  k  l  Wave#  2theta       d      2theta       d
   10.9487 8.095322   1  0  1    2   10.9572  8.089041    0.0085  0.006280
   18.0873 4.908121   3  0  0    2   18.0946  4.906144    0.0073  0.001977
   18.3978 4.825852   2  1  1    2   18.4066  4.823572    0.0088  0.002279
   19.3115 4.599195   0  1  2    2   19.3131  4.598818    0.0016  0.000376
   20.9084 4.250911   2  2  0    2   20.9187  4.248846    0.0103  0.002065
   23.6612 3.761611  -1  4  1    2   23.6618  3.761517    0.0006  0.000094
   27.6518 3.226581   0  0  3    2   27.6441  3.227468   -0.0077 -0.000887
   32.3179 2.770167  -2  5  2    2   32.3256  2.769527    0.0077  0.000641
   34.9148 2.569674   4 -2  3    2   34.9093  2.570070   -0.0055 -0.000396
   46.1261 1.967442   3  2  4    2   46.1291  1.967320    0.0030  0.000123
   46.5732 1.949579   1  7  0    2   46.5751  1.949504    0.0019  0.000075
   54.6144 1.679859  -2  5  5    2   54.6151  1.679840    0.0007  0.000019
   74.0342 1.279847   3  2  7    2   74.0258  1.279971   -0.0084 -0.000124
   74.5285 1.272575   6  4  5    2   74.5285  1.272575    0.0000  0.000000
   75.0422 1.265130   4  9  1    2   75.0300  1.265306   -0.0122 -0.000176
   85.0995 1.139391  -2  5  8    2   85.1057  1.139324    0.0062  0.000067
   86.3916 1.125629   9  6  0    2   86.3995  1.125547    0.0079  0.000082

 rmse = 0.00007401660
 
     A =16.9954(6)             B =16.9954(6)              C =9.6824(4)           
 Alpha =90                  Beta =90                  Gamma =120                 
 
 Volume = 2422.0(2)